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Bis{2-[hydroxy(diphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-yl}acetonitrile
SpectraBase Compound ID vrmsy1UbZK
InChI InChI=1S/C36H33N3O2/c37-25-30(31-21-23-33(38-31)35(40,26-13-5-1-6-14-26)27-15-7-2-8-16-27)32-22-24-34(39-32)36(41,28-17-9-3-10-18-28)29-19-11-4-12-20-29/h1-20,30,33-34,40-41H,21-24H2
InChIKey YLPITKHDGQEUQI-UHFFFAOYSA-N
Mol Weight 539.7 g/mol
Molecular Formula C36H33N3O2
Exact Mass 539.257277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xmHVwGcYbv
Name Bis{2-[hydroxy(diphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-yl}acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H33N3O2
InChI InChI=1S/C36H33N3O2/c37-25-30(31-21-23-33(38-31)35(40,26-13-5-1-6-14-26)27-15-7-2-8-16-27)32-22-24-34(39-32)36(41,28-17-9-3-10-18-28)29-19-11-4-12-20-29/h1-20,30,33-34,40-41H,21-24H2
InChIKey YLPITKHDGQEUQI-UHFFFAOYSA-N
Molecular Weight 539.679 g/mol
SMILES OC(C1N=C(C(C2=NC(C(c3ccccc3)(c3ccccc3)O)CC2)C#N)CC1)(c1ccccc1)c1ccccc1
SPLASH splash10-066r-3903000000-70fbc39ce1cb1c78acc7
Wiley ID 1486543